Volume 107; Issue 14

Journal of Physical Chemistry A

Volume 107; Issue 14

1

Infrared Spectra of BCO, B(CO)2, and OCBBCO in Solid Argon

Zhou, Mingfei, Tsumori, Nobuko, Andrews, Lester, Xu, Qiang

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 120 KB

english, 2003

2

Complexes of Hydroperoxyl Radical with Glyoxal, Methylglyoxal, Methylvinyl Ketone, Acrolein, and Methacrolein: Possible New Sinks for HO 2 in the Atmosphere?

Aloisio, S., Francisco, Joseph S.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 55 KB

english, 2003

3

State-to-State Rate Constant Calculations for V−V Energy Transfer in CO−N 2 Collisions

Kurnosov, A., Cacciatore, M., Billing, G. D.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 114 KB

english, 2003

4

Picosecond Time-Resolved Resonance Raman Study of the Solvated Electron in Water

Mizuno, Misao, Tahara, Tahei

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 456 KB

english, 2003

5

Systematic Investigation of Modern Quantum Chemical Methods to Predict Electronic Circular Dichroism Spectra

Diedrich, Christian, Grimme, Stefan

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 202 KB

english, 2003

6

The End of a 30-Year-Old Controversy? A Computational Study of the B−N Stretching Frequency of BH 3 −NH 3 in the Solid State

Dillen, Jan, Verhoeven, Paul

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 266 KB

english, 2003

7

Density Functional Study of the Interaction of H 2 , N 2 , O 2 , CO, and NO Diatomic Molecules with H - , Li - , and F - Anions. Prediction of a New Type of Anion Cluster

Matsubara, Toshiaki, Hirao, Kazuyuki

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 274 KB

english, 2003

8

Slow Infrared Laser Dissociation of Biomolecules in the Rapid Energy Exchange Limit

Paech, Kolja, Jockusch, Rebecca A., Williams, Evan R.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 11 KB

english, 2003

9

Direct Photophysical Evidence for Quenching of the Triplet Excited State of 2,4,6-Triphenyl(thia)pyrylium Salts by 2,3-Diaryloxetanes

Miranda, Miguel A., Izquierdo, M. Angeles, Pérez-Ruiz, Raúl

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 86 KB

english, 2003

10

Photolysis of Oxalyl Chloride (ClCO) 2 at 248 nm: Emission of CO( v ‘ ⩽ 3, J ‘ ⩽ 51) Detected with Time-Resolved Fourier Transform Spectroscopy

Wu, Chia-Yan, Lee, Yuan-Pern, Ogilvie, J. F., Wang, Niann S.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 106 KB

english, 2003

11

Matrix Infrared Spectra and ab Initio Calculations of the Formohydroxamic Acid Complexes with HF and HCl

Sałdyka, Magdalena, Mielke, Zofia

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 125 KB

english, 2003

12

Al 3 O 4 and Al 3 O 4- Clusters: Structure, Bonding, and Electron Binding Energies

Martínez, Ana, Tenorio, Francisco J., Ortiz, J. V.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 531 KB

english, 2003

13

Calcium Photorelease from a Symmetrical Donor−Acceptor−Donor Bis-crown-fluoroionophore Evidenced by Ultrafast Absorption Spectroscopy

Marcotte, Nathalie, Plaza, Pascal, Lavabre, Dominique, Fery-Forgues, Suzanne, Martin, Monique M.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 172 KB

english, 2003

14

Kinetic Study of the Self-Reactions of the BrCH 2 CH 2 O 2 and BrCH(CH 3 )CH(CH 3 )O 2 Radicals between 275 and 373 K

Villenave, Eric, Moisan, Sandy, Lesclaux, Robert

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 121 KB

english, 2003

15

Luminescent Compounds f ac - and m er -Aluminum Tris(quinolin-8-olate). A Pure and Hybrid Density Functional Theory and Time-Dependent Density Functional Theory Investigation of Their Electronic and Spectroscopic Properties

Amati, Mario, Lelj, Francesco

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 149 KB

english, 2003

16

Collision-Free Lifetimes of SO(B 3 Σ - , v ‘ = 0, 1, and 2) and Vibrational Level Dependence of Deactivation by He

Yamasaki, Katsuyoshi, Taketani, Fumikazu, Tomita, Sachie, Sugiura, Kazuyuki, Tokue, Ikuo

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 145 KB

english, 2003

17

Influence of Confinement on the Solvation and Rotational Dynamics of Coumarin 153 in Ethanol

Baumann, Robert, Ferrante, Camilla, Kneuper, Erwin, Deeg, Fred-Walter, Bräuchle, Christoph

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 154 KB

english, 2003

18

Two-Dimensional Analysis of Integrated Three-Pulse Photon Echo Signals of Nile Blue Doped in PMMA

Nagasawa, Yutaka, Seike, Kazushige, Muromoto, Takayuki, Okada, Tadashi

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 618 KB

english, 2003

19

Direct Kinetic Study of the Reaction of Cl 2•- Radical Anions with Ethanol at the Air−Water Interface

Strekowski, R. S., Remorov, R., George, Ch.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 142 KB

english, 2003

20

Modern Valence-Bond Description of Chemical Reaction Mechanisms: The 1,3-Dipolar Addition of Methyl Azide to Ethene

Blavins, Joshua J., Karadakov, Peter B., Cooper, David L.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 419 KB

english, 2003

21

Coupled Cluster/Molecular Mechanics Method: Implementation and Application to Liquid Water

Kongsted, Jacob, Osted, Anders, Mikkelsen, Kurt V., Christiansen, Ove

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 135 KB

english, 2003

22

Unexpected Sensitization Efficiency of the Near-Infrared Nd 3+ , Er 3+ , and Yb 3+ Emission by Fluorescein Compared to Eosin and Erythrosin

Hebbink, Gerald A., Grave, Lennart, Woldering, Léon A., Reinhoudt, David N., van Veggel, Frank C. J. M.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 247 KB

english, 2003

23

EXAFS and Density Functional Study of Gold(I) Thiosulfate Complex in Aqueous Solution

Bryce, Richard A., Charnock, John M., Pattrick, Richard A. D., Lennie, Alistair R.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 108 KB

english, 2003

24

Substitution and Elimination Reaction of F - with C 2 H 5 Cl: An ab Initio Molecular Dynamics Study

Mugnai, Martina, Cardini, Gianni, Schettino, Vincenzo

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 324 KB

english, 2003

25

High-Temperature Reactions of O + COS and S + SO 2 . Abstraction versus Substitution Channels

Isshiki, Nobuyasu, Murakami, Yoshinori, Tsuchiya, Kentaro, Tezaki, Atsumu, Matsui, Hiroyuki

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 118 KB

english, 2003

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